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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Tetrahydrofuran → Methyl (5,7-dimethyl-2-oxo-3-{2-oxo-2-[(2'-oxo-1',2',5,7-tetrahydrospiro[cyclopenta[b]pyridine-6,3'-pyrrolo[2,3-b]pyridin]-3-yl)amino]ethyl}-2,3-dihydro-1H-benzimidazol-1-yl)acetate

HRID 1119341
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HRID 1119341 반응식
[CH2:50]1[O:51][CH2:52][CH2:53][CH2:54]1.[CH3:1][O:2][C:3]([CH2:4][n:5]1[c:6](=[O:20])[n:7]([CH2:16][C:17](=[O:18])[OH:19])[c:8]2[c:9]1[c:10]([CH3:15])[cH:11][c:12]([CH3:14])[cH:13]2)=[O:21].[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[NH2:22][c:23]1[cH:24][c:25]2[c:26]([n:27][cH:28]1)[CH2:29][C:30]1([CH2:31]2)[C:32](=[O:40])[NH:33][c:34]2[n:35][cH:36][cH:37][cH:38][c:39]21>>[CH3:1][O:2][C:3]([CH2:4][n:5]1[c:6](=[O:20])[n:7]([CH2:16][C:17](=[O:19])[NH:22][c:23]2[cH:24][c:25]3[c:26]([n:27][cH:28]2)[CH2:29][C:30]2([CH2:31]3)[C:32](=[O:40])[NH:33][c:34]3[n:35][cH:36][cH:37][cH:38][c:39]32)[c:8]2[c:9]1[c:10]([CH3:15])[cH:11][c:12]([CH3:14])[cH:13]2)=[O:21]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 8028TetrahydrofuranHCID 81531DiisopropylethylamineHCID 18449372[3-(2-Methoxy-2-oxoethyl)-4,6-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl]acetic acidHCID 579740903-amino-5,7-dihydrospiro[cyclopenta-[b]pyridin-6.3'-pyrrolo[2,3-b]pyridin]-2'(1'H)-one

생성물 1

HCID 25143872
Methyl (5,7-dimethyl-2-oxo-3-{2-oxo-2-[(2'-oxo-1',2',5,7-tetrahydrospiro[cyclopenta[b]pyridine-6,3'-pyrrolo[2,3-b]pyridin]-3-yl)amino]ethyl}-2,3-dihydro-1H-benzimidazol-1-yl)acetate

출처 및 근거

ORD 기록
ord-b1a90e82068c4df5acccacd7b8d7cd64
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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